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Compound Detail

CHEMBL29404

ENECADIN
🧪 Phase II
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🧪 Phase II
Cc1nc(OCCCCCN2CCCCC2)cc(-c2ccc(F)cc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL29404
Name ENECADIN
Phase Phase II
Structure Type MOL
InChI Key SZSHJTJCJOWMHM-UHFFFAOYSA-N

Known Names

Enecadin Enecadina Enecadine
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
3
Known Names
1
Indications

Molecular Properties

357.5
MW (Da)
4.63
ALogP
4
HBA
0
HBD
38.2
PSA (Ų)
0.65
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Extended Properties

Molecular Formula C21H28FN3O
MW 357.47
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -1.59

Indications

Stroke

Activity Summary

IC50 2 meas. best 6.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
 IC50 6.0 5.555 1000.0 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 1000.0 nM 6.0 Inhibition of [3H]-BTX binding to cardiac voltage-gated sodium channel 11170622
Unchecked IC50 = 7700.0 nM 5.11 Inhibition of veratridine-induced guanidine flux in cardiac voltage-gated sodium... 11170622

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4651402 SARS-CoV-2 4
11170622 10.1021/jm000155h Unchecked 2
11170622 10.1021/jm000155h Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine